1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-[[(Z)-octadec-9-enyl]amino]pyrimidin-2-one

Base Information

• Chemical Name: 1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-[[(Z)-octadec-9-enyl]amino]pyrimidin-2-one
• CAS No.: 130252-71-0
• Molecular Formula: C27H47 N3 O5
• Molecular Weight: 493.68
• Mol file: 130252-71-0.mol

Synonyms:N(4)-oleylcytosine arabinoside;NOAC

Chemical Property of 1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-[[(Z)-octadec-9-enyl]amino]pyrimidin-2-one

Chemical Property:

• Vapor Pressure: 6.12E-20mmHg at 25°C
• Boiling Point: 655.1°Cat760mmHg
• Flash Point: 350°C
• PSA: 120.33000
• Density: 1.16g/cm³
• LogP: 4.13840
• XLogP3: 6.2
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 19
• Exact Mass: 493.35157161
• Heavy Atom Count: 35
• Complexity: 682

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCCNC1=NC(=O)N(C=C1)C2C(C(C(O2)CO)O)O
• Isomeric SMILES: CCCCCCCC/C=C\CCCCCCCCNC1=NC(=O)N(C=C1)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)O